⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL1245259 | 0.75 | — | — | |
| SCHEMBL2477369 | 0.62 | — | — | |
| SCHEMBL39713 | 0.62 | — | — | |
| SCHEMBL7977882 | 0.59 | — | — | |
| SCHEMBL9172246 | 0.59 | — | — | |
| SCHEMBL1504634 | 0.59 | — | — | |
| SCHEMBL6883549 | 0.59 | — | — | |
| SCHEMBL7100546 | 0.59 | — | — | |
| SCHEMBL497416 | 0.59 | — | — | |
| SCHEMBL38257 | 0.53 | — | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2015011331-A1 | USE OF COMPOUNDS DERIVED FROM PYRIDAZINO[1',6':1,2]PYRIDO[3,4-B]INDOLE AND PYRIDAZINO[3,2-B]BENZIMIDAZOLE SALTS AS ANTI-INFLAMMATORY AGENTS | FUNDACIÓN PARA LA INVESTIGACIÓN BIOMÉDICA DEL HOSPITAL UNIVERSITARIO LA PAZ (FIBHULP) (ES) | 2015-01-29 | — | — | WO | disclosed |
| WO-2014202814-A1 | FLOURESCENT COMPOUNDS | UNIVERSIDADE DE SANTIAGO DE COMPOSTELA (ES) | 2014-12-24 | — | — | WO | disclosed |
| US-6780348-B1 | COMPOSITION COMPRISING MIXTURE OF POLYBROMODIPHENYLALKANE IN WHICH PHENYL GROUPS ARE SUBSTITUTED BY AT LEAST 6 BROMINE ATOMS AND ALKANE PORTION OF MOLECULE CONTAINS 1 TO 3 CARBON ATOMS, AND TETRABROMOBISPHENOL-A-BIS(BROMOALKYL ETHER) | ALBEMARLE CORPORATION | 2004-08-24 | — | — | US | disclosed |